2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane

C17H30Si — CID 10515650

IUPAC2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane
SMILESC[Si](C)(C)C#C/C1=C\CCCCCCCCCC1
InChIInChI=1S/C17H30Si/c1-18(2,3)16-15-17-13-11-9-7-5-4-6-8-10-12-14-17/h13H,4-12,14H2,1-3H3/b17-13-
InChIKeyHVVOZLABFYVRFG-LGMDPLHJSA-N
MW262.51 g/mol
LogP5.71
Rot. Bonds

About 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane

2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane (PubChem CID 10515650) has the molecular formula C17H30Si and a molecular weight of 262.51 g/mol. Its IUPAC name is 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane.

Molecular Properties

Compound Name2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane
PubChem CID10515650
Molecular FormulaC17H30Si
Molecular Weight262.51 g/mol
Exact Mass262.21
IUPAC Name2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane
SMILESC[Si](C)(C)C#C/C1=C\CCCCCCCCCC1
InChIInChI=1S/C17H30Si/c1-18(2,3)16-15-17-13-11-9-7-5-4-6-8-10-12-14-17/h13H,4-12,14H2,1-3H3/b17-13-
InChIKeyHVVOZLABFYVRFG-LGMDPLHJSA-N
XLogP5.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.51
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(1-Cyclohexen-1-ylethynyl)trimethylsilane
CID 11816203
1-[2-(Trimethylsilyl)ethynyl]cyclopentene
CID 12778987
2-(Cyclohexen-1-yl)ethynyl-triethyl-silane
CID 134948291
[5-(Cyclohexen-1-yl)-3,3-difluoropenta-1,4-diynyl]-tri(propan-2-yl)silane
CID 177849926
[(4E)-5,9-dimethyldeca-4,8-dien-1-ynyl]-trimethylsilane
CID 10354026
[(E)-3-butyl-2-methyl-5-methylidenenon-2-enyl]-triethylsilane
CID 101777994
2-(Cyclohexen-1-yl)ethynyl-tri(propan-2-yl)silane
CID 101856172
Triisopropyl(3-methylenenon-1-yn-1-yl)silane
CID 102088940
[(5E)-6,10-dimethylundeca-5,9-dien-1-ynyl]-trimethylsilane
CID 12489209
2-(Cyclohexen-1-yl)ethyl-trimethylsilane
CID 18764452
trimethyl-[(E)-5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluoro-3-hexyldec-3-en-1-ynyl]silane
CID 10768442
Silane, trimethyl(6-methyl-5-hepten-1-ynyl)-
CID 550064

Frequently Asked Questions

What is the IUPAC name of 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane?
The IUPAC name of 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane (CID 10515650) is 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane.
What is the SMILES notation for 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane?
The canonical SMILES for 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane is C[Si](C)(C)C#C/C1=C\CCCCCCCCCC1.
What is the InChIKey of 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane?
The InChIKey is HVVOZLABFYVRFG-LGMDPLHJSA-N. The full InChI is InChI=1S/C17H30Si/c1-18(2,3)16-15-17-13-11-9-7-5-4-6-8-10-12-14-17/h13H,4-12,14H2,1-3H3/b17-13-.
What are the key properties of 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane?
2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane has a molecular weight of 262.51 g/mol, XLogP of 5.71, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1Z)-cyclododecen-1-yl]ethynyl-trimethylsilane is sourced from PubChem (CID 10515650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).